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tsoc
openmm
Commits
105b196e
Commit
105b196e
authored
Oct 30, 2014
by
peastman
Browse files
Merge pull request #684 from peastman/master
Minor updates to manual for 6.2.
parents
10c5a10f
da2e8c92
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docs-source/usersguide/application.rst
docs-source/usersguide/application.rst
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docs-source/usersguide/library.rst
docs-source/usersguide/library.rst
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docs-source/usersguide/application.rst
View file @
105b196e
...
...
@@ -43,15 +43,13 @@ troubleshooting guide that describes common problems and how to fix them
Installing
on
Mac
OS
X
**********************
OpenMM
works
on
Mac
OS
X
10.7
or
later
.
GPU
acceleration
is
currently
only
supported
on
Nvidia
GPUs
,
not
on
AMD
or
Intel
GPUs
.
OpenMM
works
on
Mac
OS
X
10.7
or
later
.
..
warning
::
A
serious
bug
was
introduced
in
Mac
OS
X
10.7.5
that
prevents
OpenMM
’
s
OpenCL
platform
from
working
correctly
.
At
the
time
of
this
writing
,
the
bug
is
present
in
all
versions
from
10.7.5
onward
.
The
CUDA
platform
(
see
below
)
is
not
affected
by
the
bug
,
so
if
you
have
an
affected
version
of
OS
X
,
you
should
use
it
instead
of
the
OpenCL
platform
.
..
note
::
The
OpenCL
implementations
on
all
recent
versions
of
Mac
OS
X
contain
serious
bugs
that
make
them
unsuitable
for
use
with
OpenMM
.
GPU
acceleration
is
therefore
only
supported
with
the
CUDA
platform
.
This
limits
it
to
only
Nvidia
GPUs
,
not
AMD
or
Intel
GPUs
.
1.
Download
the
pre
-
compiled
binary
of
OpenMM
for
Mac
OS
X
,
then
double
click
the
.
zip
file
to
expand
it
.
...
...
@@ -63,7 +61,7 @@ and tell it to install the command line tools. With Xcode 4.2 and earlier, the
command
line
tools
are
automatically
installed
when
you
install
Xcode
.)
3.
(
Optional
)
If
you
have
an
Nvidia
GPU
and
want
to
use
the
CUDA
platform
,
download
CUDA
6.
0
from
https
://
developer
.
nvidia
.
com
/
cuda
-
downloads
.
Be
sure
to
download
CUDA
6.
5
from
https
://
developer
.
nvidia
.
com
/
cuda
-
downloads
.
Be
sure
to
install
both
the
drivers
and
toolkit
.
4.
(
Optional
)
If
you
plan
to
use
the
CPU
platform
,
it
is
recommended
that
you
...
...
@@ -139,7 +137,7 @@ into a console window.
3.
(
Optional
)
If
you
want
to
run
OpenMM
on
a
GPU
,
install
CUDA
and
/
or
OpenCL
.
*
If
you
have
an
Nvidia
GPU
,
download
CUDA
6.
0
from
*
If
you
have
an
Nvidia
GPU
,
download
CUDA
6.
5
from
https
://
developer
.
nvidia
.
com
/
cuda
-
downloads
.
Be
sure
to
install
both
the
drivers
and
toolkit
.
OpenCL
is
included
with
the
CUDA
drivers
.
*
If
you
have
an
AMD
GPU
,
download
the
latest
version
of
the
Catalyst
driver
...
...
@@ -222,11 +220,9 @@ and ignore it.)
4.
(
Optional
)
If
you
want
to
run
OpenMM
on
a
GPU
,
install
CUDA
and
/
or
OpenCL
.
*
If
you
have
an
Nvidia
GPU
,
download
CUDA
6.
0
from
*
If
you
have
an
Nvidia
GPU
,
download
CUDA
6.
5
from
https
://
developer
.
nvidia
.
com
/
cuda
-
downloads
.
Be
sure
to
install
both
the
drivers
and
toolkit
.
For
64
-
bit
machines
,
you
should
install
the
64
-
bit
driver
,
but
download
the
32
-
bit
version
of
the
toolkit
since
the
OpenMM
binary
is
32
-
bit
.
OpenCL
is
included
with
the
CUDA
drivers
.
drivers
and
toolkit
.
OpenCL
is
included
with
the
CUDA
drivers
.
*
If
you
have
an
AMD
GPU
,
download
the
latest
version
of
the
Catalyst
driver
from
http
://
support
.
amd
.
com
.
...
...
docs-source/usersguide/library.rst
View file @
105b196e
...
...
@@ -434,7 +434,7 @@ To download and unpack OpenMM source code:
Alternatively
,
if
you
want
the
most
recent
development
version
of
the
code
rather
than
the
version
corresponding
to
a
particular
release
,
you
can
get
it
from
https
://
github
.
com
/
SimTk
/
openmm
.
Be
aware
that
the
development
code
is
constantly
https
://
github
.
com
/
pandegroup
/
openmm
.
Be
aware
that
the
development
code
is
constantly
changing
,
may
contain
bugs
,
and
should
never
be
used
for
production
work
.
If
you
want
a
stable
,
well
tested
version
of
OpenMM
,
you
should
download
the
source
code
for
the
latest
release
as
described
above
.
...
...
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